Geometry & MOs

Info

ID:	314060
PubChem CID:	126620211
Reduced:	FNO2C14H20 (1)
Stoich.:	ABC2D14E20 (1)
Weight, g/mol:	247.120843
ΔH_f, kcal/mol:	-126.26
Dipole, Da:	1.7
IP(EA), eV:	-8.94(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-[(2S)-1-(methylamino)propan-2-yl]oxy-1-benzofuran-2-yl]ethanone

Drug info:

PubChemData

Smile

CC(CNC)OC1=CC(=C(C=C1)F)CCC(=O)C

DOS

IR

Vibrations